3-methyl-4-[4-(methylsulfanyl)phenyl]-7-phenyl-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
Chemical Structure Depiction of
3-methyl-4-[4-(methylsulfanyl)phenyl]-7-phenyl-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
3-methyl-4-[4-(methylsulfanyl)phenyl]-7-phenyl-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one
Compound characteristics
| Compound ID: | D526-0132 |
| Compound Name: | 3-methyl-4-[4-(methylsulfanyl)phenyl]-7-phenyl-4,7,8,9-tetrahydro[1,2]oxazolo[5,4-b]quinolin-5(6H)-one |
| Molecular Weight: | 402.51 |
| Molecular Formula: | C24 H22 N2 O2 S |
| Smiles: | Cc1c2C(C3=C(CC(CC3=O)c3ccccc3)Nc2on1)c1ccc(cc1)SC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3256 |
| logD: | 2.9499 |
| logSw: | -5.3365 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.439 |
| InChI Key: | FUNIOAIXWHMWPU-UHFFFAOYSA-N |